CID 85665

13972-95-7

Structural Information

Molecular Formula

C₁₉H₂₃N

SMILES

CNCCCC1(CCC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C19H23N/c1-20-15-7-13-19(17-9-3-2-4-10-17)14-12-16-8-5-6-11-18(16)19/h2-6,8-11,20H,7,12-15H2,1H3

InChIKey

GOTWTZXJKNEPIR-UHFFFAOYSA-N

Compound name

N-methyl-3-(1-phenyl-2,3-dihydroinden-1-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 265.18304 Da
Monoisotopic Mass: 4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	266.190316	164.3
[M+Na]+	288.172258	170.3
[M-H]-	264.175764	171.3
[M+NH4]+	283.216863	185.2
[M+K]+	304.146198	164.7
[M+H-H2O]+	248.180300	156.7
[M+HCOO]-	310.181241	187.3
[M+CH3COO]-	324.196891	176.0
[M+Na-2H]-	286.157706	169.7
[M]+	265.18249142	163.2
[M]-	265.18358858	163.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe